Synthesis and physical properties of multiferroic BaDyFeO4
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Keywords

multiferroic
synthetic procedure
crystal structure
semiconductor
DFT calculation

How to Cite

1.
Le TPT, Do DB, Dinh TK, Tran TA, Le VTS, Dang NT, Nguyen TT. Synthesis and physical properties of multiferroic BaDyFeO4. hueuni-jns [Internet]. 2023Jun.30 [cited 2024May15];132(1B):65-72. Available from: https://jos.hueuni.edu.vn/index.php/hujos-ns/article/view/6912

Abstract

Materials exhibiting magnetoelectric effects have drawn great interest because of their intriguing physical phenomena and potential applications in electronic devices. The magnetoelectric (ME) coupling makes the materials promising for use in multifunctional devices with electric-field-tunable magnetism and magnetic-field-controlled ferroelectricity. Very recently, a strong ME effect has been found in the BaRFeO4 system (R is a rare-earth element), in which the ferroelectricity is driven by the onset of a long-range cycloidal antiferromagnetic order of Fe spins. However, previous studies have shown how complicated the synthesis procedure is to obtain single-phase samples of the materials. In this work, we present a simple and easy fabrication process to synthesise high-quality BaDyFeO4 using the conventional solid-state reaction method. The structural, morphological, and optical properties of the synthesised sample were investigated by means of X-ray diffraction, scanning electron microscopy, and UV-Vis spectroscopy, respectively. The sample was formed from high-quality microparticles. The X-ray diffraction study reveals the single-phase nature of the sample adopting the Pnma orthorhombic structure without any impurity phases. The detailed structural parameters were refined with Rietveld refinement. The sample demonstrates a direct gap semiconducting behaviour. The experimental results of the structural and electronic properties of BaDyFeO4 are complemented by density functional theory (DFT) calculations.

https://doi.org/10.26459/hueunijns.v132i1B.6912
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References

  1. Chu YH, Martin LW, Holcomb MB, Gajek M, Han SJ, He Q, et al. Electric-field control of local ferromagnetism using a magnetoelectric multiferroic. Nat Mater. 2008;7(6):478-82.
  2. Laukhin V, Skumryev V, Martí X, Hrabovsky D, Sánchez F, García-Cuenca MV, et al. Electric-field control of exchange bias in multiferroic epitaxial heterostructures. Phys Rev Lett. 2006;97(22):227201.
  3. Van Den Brink J, Khomskii DI. Multiferroicity due to charge ordering. J Phys Condens Matter. 2008;20(43):434217.
  4. Lorenz B, Wang YQ, Chu CW. Ferroelectricity in perovskite HoMnO3 and YMnO3. Phys Rev B. 2007;76(10):104405.
  5. Fiebig M. Revival of the magnetoelectric effect. J Phys D Appl Phys. 2005;38(8):R123-52.
  6. Fiebig M, Lottermoser T, Meier D, Trassin M. The evolution of multiferroics. Nat Rev Mater. 2016;1(8):16046.
  7. Lawes G, Harris AB, Kimura T, Rogado N, Cava RJ, Aharony A, et al. Magnetically driven ferroelectric order in Ni3V2O8. Phys Rev Lett. 2005;95(8):087205.
  8. Belik AA, Terada N, Katsuya Y, Tanaka M, Glazkova IS, Sobolev AV, et al. Synthesis, structure, and magnetic and dielectric properties of magnetoelectric BaDyFeO4 ferrite. J Alloys Compd. 2019;811:151963.
  9. Glazkova IS, Belik AA, Sobolev A V., Smirnova MN, Ovanesyan NS, Presniakov IA. Modulated Magnetic Structures in BaRFeO4 ( R = Y and Dy): Magnetic and 57Fe Mössbauer Investigations. J Phys Chem C. 2020;124(24):13374-84.
  10. Ghara S, Sundaresan A. Coexistence of long-range cycloidal order and spin-cluster glass state in the multiferroic BaYFeO4. J Phys Condens Matter. 2018 ;30(24):245802.
  11. Rodríguez-Carvajal J. Recent advances in magnetic structure determination by neutron powder diffraction. Phys B. 1993;192(1-2):55-69.
  12. Giannozzi P, Andreussi O, Brumme T, Bunau O, Buongiorno Nardelli M, Calandra M, et al. Advanced capabilities for materials modelling with Quantum ESPRESSO. J Phys Condens Matter. 2017;29(46):465901.
  13. Giannozzi P, Baroni S, Bonini N, Calandra M, Car R, Cavazzoni C, et al. QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. J Phys Condens Matter. 2009;21(39):395502.
  14. Perdew JP, Wang Y. Accurate and simple density functional for the electronic exchange energy: Generalized gradient approximation. Phys Rev B. 1986;33(12):8800-2.
  15. Perdew JP, Burke K, Ernzerhof M. Generalized Gradient Approximation Made Simple. Phys Rev Lett. 1996;77(18):3865-8.
  16. Anisimov VI, Zaanen J, Andersen OK. Band theory and Mott insulators: Hubbard U instead of Stoner I. Phys Rev B. 1991;44(3):943-54.
  17. Monkhorst HJ, Pack JD. Special points for Brillouin-zone integrations. Phys Rev B. 1976;13(12):5188-92.
  18. Phong LTH, Dang NT, Dang NV, Nguyen V-Q, Manh DH, Nam PH, et al. Structural, optical and conductivity properties in tetragonal BaTi1−xCoxO3 ( 0≤ x ≤ 0.1). RSC Adv. 2022;12(25):16119-30.
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